Vitas-M small molecule compound
(3aS,4R,9bR)-8-ethoxy-4-(4-nitrophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
Catalog ID
STL222063
SMILES CCOc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](N2)c1ccc(cc1)[N+](=O)[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H20N2O3 MW 336.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O3/c1-2-25-15-10-11-19-18(12-15)16-4-3-5-17(16)20(21-19)13-6-8-14(9-7-13)22(23)24/h3-4,6-12,16-17,20-21H,2,5H2,1H3/t16-,17+,20+/m1/s1InChIKey
WBBTXVLXSCOTRE-UWVAXJGDSA-NSynonyms
(3aS4R9bR)8ethoxy4(4nitrophenyl)3a459btetrahydro3Hcyclopenta(c)quinoline
CCOC1=CC2=C(C=C1)NC(C3C2C=CC3)C4=CC=C(C=C4)(N+)(=O)(O)
CCOc1ccc2c(c1)(C@@H)1C=CC(C@@H)1(C@@H)(N2)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC20H20N2O3c12251510111918(1215)1643517(16)20(2119)136814(9713)22(23)24h3461216172021H25H21H3t1617+20+m1s1
MFCD24857605
ZINC000002883333
ZINC02883333
ZINC2883333
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